ethyl 1,2,5-trimethyl-4-(3-piperidin-1-ylcarbonylpiperidin-1-yl)sulfonyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1,2,5-trimethyl-4-(3-piperidin-1-ylcarbonylpiperidin-1-yl)sulfonyl-pyrrole-3-carboxylate Openeye Name: ethyl 1,2,5-trimethyl-4-[[3-(piperidine-1-carbonyl)-1-piperidyl]sulfonyl]pyrrole-3-carboxylate CAS Name: 1,2,5-trimethyl-4-[[3-[oxo(1-piperidinyl)methyl]-1-piperidinyl]sulfonyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,2,5-trimethyl-4-[3-(piperidine-1-carbonyl)piperidin-1-yl]sulfonylpyrrole-3-carboxylate Traditional Name: 1,2,5-trimethyl-4-[3-(piperidine-1-carbonyl)piperidino]sulfonyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCCC(C2)C(=O)N3CCCCC3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCCC(C2)C(=O)N3CCCCC3)C)C)C

InChI

InChI=1S/C21H33N3O5S/c1-5-29-21(26)18-15(2)22(4)16(3)19(18)30(27,28)24-13-9-10-17(14-24)20(25)23-11-7-6-8-12-23/h17H,5-14H2,1-4H3